2-[2-(benzotriazol-1-yl)ethanoyl-(4-methylphenyl)amino]-N-(phenylmethyl)-2-thiophen-2-yl-ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(4-methylphenyl)amino]-N-(phenylmethyl)-2-thiophen-2-yl-ethanamide Openeye Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-methyl-anilino)-N-benzyl-2-(2-thienyl)acetamide CAS Name: 2-(N-[2-(1-benzotriazolyl)-1-oxoethyl]-4-methylanilino)-N-(phenylmethyl)-2-thiophen-2-ylacetamide IUPAC Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-methylanilino)-N-benzyl-2-thiophen-2-ylacetamide Traditional Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-methyl-anilino)-N-benzyl-2-(2-thienyl)acetamide Formula: C28H25N5O2S MolecularWeight: 495.5954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(C2=CC=CS2)C(=O)NCC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=CC=C(C=C1)N(C(C2=CC=CS2)C(=O)NCC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C28H25N5O2S/c1-20-13-15-22(16-14-20)33(26(34)19-32-24-11-6-5-10-23(24)30-31-32)27(25-12-7-17-36-25)28(35)29-18-21-8-3-2-4-9-21/h2-17,27H,18-19H2,1H3,(H,29,35)